4-indol-1-yl-2-(propan-2-ylamino)-1-pyridin-2-yl-5H-1,4-diazepine-3-carbaldehyde

Systemtic Name: 4-indol-1-yl-2-(propan-2-ylamino)-1-pyridin-2-yl-5H-1,4-diazepine-3-carbaldehyde Openeye Name: 4-indol-1-yl-2-(isopropylamino)-1-(2-pyridyl)-5H-1,4-diazepine-3-carbaldehyde CAS Name: 4-(1-indolyl)-2-(propan-2-ylamino)-1-(2-pyridinyl)-5H-1,4-diazepine-3-carboxaldehyde IUPAC Name: 4-indol-1-yl-2-(propan-2-ylamino)-1-pyridin-2-yl-5H-1,4-diazepine-3-carbaldehyde Traditional Name: 4-indol-1-yl-2-(isopropylamino)-1-(2-pyridyl)-5H-1,4-diazepine-3-carbaldehyde Formula: C22H23N5O MolecularWeight: 373.45092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(N(CC=CN1C2=CC=CC=N2)N3C=CC4=CC=CC=C43)C=O

Isomeric SMILES

CC(C)NC1=C(N(CC=CN1C2=CC=CC=N2)N3C=CC4=CC=CC=C43)C=O

InChI

InChI=1S/C22H23N5O/c1-17(2)24-22-20(16-28)26(27-15-11-18-8-3-4-9-19(18)27)14-7-13-25(22)21-10-5-6-12-23-21/h3-13,15-17,24H,14H2,1-2H3